N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide

C25H17F3N2O4 — CID 68862614

IUPACN'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide
SMILESO=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)c(C(F)(F)F)c1
InChIInChI=1S/C25H17F3N2O4/c26-25(27,28)19-13-17(11-12-20(19)31)23(32)29-30-24(33)22-21(16-9-5-2-6-10-16)18(14-34-22)15-7-3-1-4-8-15/h1-14,31H,(H,29,32)(H,30,33)
InChIKeyYFKJFXJIVQHGHP-UHFFFAOYSA-N
MW466.42 g/mol
LogP5.41
Rot. Bonds4

About N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide

N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide (PubChem CID 68862614) has the molecular formula C25H17F3N2O4 and a molecular weight of 466.42 g/mol. Its IUPAC name is N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide.

Molecular Properties

Compound NameN'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide
PubChem CID68862614
Molecular FormulaC25H17F3N2O4
Molecular Weight466.42 g/mol
Exact Mass466.11
IUPAC NameN'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide
SMILESO=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)c(C(F)(F)F)c1
InChIInChI=1S/C25H17F3N2O4/c26-25(27,28)19-13-17(11-12-20(19)31)23(32)29-30-24(33)22-21(16-9-5-2-6-10-16)18(14-34-22)15-7-3-1-4-8-15/h1-14,31H,(H,29,32)(H,30,33)
InChIKeyYFKJFXJIVQHGHP-UHFFFAOYSA-N
XLogP5.41
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.42
LogP ≤ 55.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-[2-(2,4-dimethylphenoxy)acetyl]-2-furohydrazide
CID 876401
N'-(2-hydroxybenzoyl)-1-benzofuran-2-carbohydrazide
CID 7661749
N'-(2-hydroxybenzoyl)-2-furohydrazide
CID 393335
N'-(3-chloro-4-hydroxybenzoyl)-3,4-diphenylfuran-2-carbohydrazide
CID 68863912
N'-(3-bromo-4-hydroxybenzoyl)-3,4-diphenylfuran-2-carbohydrazide
CID 68864642
N'-(2-(4-ethylphenoxy)acetyl)benzofuran-2-carbohydrazide
CID 725700
N'-(2-hydroxy-3-methylbenzoyl)furan-2-carbohydrazide
CID 870343
N'-(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl)furan-2-carbohydrazide
CID 1146899
N'-(4-hydroxybenzoyl)-3,4-diphenylfuran-2-carbohydrazide
CID 68862222
3,4-Diphenyl-2-furancarboxylic acid 2-(4-hydroxy-3-methoxybenzoyl)hydrazide
CID 68862226
3,4-Diphenyl-2-furancarboxylic acid 2-(3-fluoro-4-hydroxybenzoyl)hydrazide
CID 68864367
N'-[2-(4-methylphenoxy)-1-oxoethyl]-2-benzofurancarbohydrazide
CID 725697

Frequently Asked Questions

What is the IUPAC name of N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide?
The IUPAC name of N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide (CID 68862614) is N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide.
What is the SMILES notation for N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide?
The canonical SMILES for N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide is O=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)c(C(F)(F)F)c1.
What is the InChIKey of N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide?
The InChIKey is YFKJFXJIVQHGHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17F3N2O4/c26-25(27,28)19-13-17(11-12-20(19)31)23(32)29-30-24(33)22-21(16-9-5-2-6-10-16)18(14-34-22)15-7-3-1-4-8-15/h1-14,31H,(H,29,32)(H,30,33).
What are the key properties of N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide?
N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide has a molecular weight of 466.42 g/mol, XLogP of 5.41, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-hydroxy-3-(trifluoromethyl)benzoyl]-3,4-diphenylfuran-2-carbohydrazide is sourced from PubChem (CID 68862614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).